SCHEMBL6079762

SCHEMBL6079762

O=C(O)NC1CCN(CCc2c(Cl)cnc3ccc(Cl)cc23)CC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.45
UBE2M P61081 1/20 0.44
DCUN1D1 Q96GG9 1/20 0.44
CNR1 P21554 4/20 0.43
SLC6A12 P48065 1/20 0.42
HTR7 P34969 1/20 0.42
SLC2A1 P11166 1/20 0.42
SIGMAR1 Q99720 2/20 0.41
MCHR1 Q99705 1/20 0.40
KCNH2 Q12809 1/20 0.40
MELK Q14680 1/20 0.39
MEN1 O00255 1/20 0.39
MAPK10 P53779 1/20 0.39
KMT2A Q03164 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6080763 0.90 CNR2 (0.44) CNR2SLC2A1SIGMAR1KCNH2MELK
SCHEMBL5747690 0.88 KCNH2 (0.50) CNR2SLC2A1KCNH2
SCHEMBL6079976 0.85 SLC2A1 (0.38) CNR2UBE2MDCUN1D1CNR1HTR7
SCHEMBL6079967 0.85 SLC2A1 (0.38) CNR2UBE2MDCUN1D1CNR1HTR7
SCHEMBL5744836 0.82 SSTR2 (0.48) CNR1SLC2A1KCNH2
SCHEMBL3984347 0.80 KCNH2 (0.39) UBE2MDCUN1D1HTR7SLC2A1SIGMAR1
SCHEMBL6079889 0.80 KCNH2 (0.47) CNR2SLC2A1SIGMAR1KCNH2
SCHEMBL5746904 0.78 KCNH2 (0.62) KCNH2
SCHEMBL5744942 0.77 SLC2A1 (0.67) CNR2HTR7SLC2A1SIGMAR1MCHR1
SCHEMBL6080508 0.76 SLC2A1 (0.40) CNR2SLC2A1KCNH2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060041123-A1 Antibacterial agents GLAXO GROUP LIMITED (GB) 2006-02-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060041123-A1 Antibacterial agents NQO2, NRDC, IFNG CNR2 4489/4885UBE2M 727/4885DCUN1D1 1966/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.